N-(4-methyl-1,3-thiazol-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide

Systemtic Name: N-(4-methyl-1,3-thiazol-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide Openeye Name: N-(4-methylthiazol-2-yl)-3-nitro-4-pyrrolidin-1-yl-benzamide CAS Name: N-(4-methyl-2-thiazolyl)-3-nitro-4-(1-pyrrolidinyl)benzamide IUPAC Name: N-(4-methyl-1,3-thiazol-2-yl)-3-nitro-4-pyrrolidin-1-ylbenzamide Traditional Name: N-(4-methylthiazol-2-yl)-3-nitro-4-pyrrolidino-benzamide Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)NC(=O)C2=CC(=C(C=C2)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C15H16N4O3S/c1-10-9-23-15(16-10)17-14(20)11-4-5-12(13(8-11)19(21)22)18-6-2-3-7-18/h4-5,8-9H,2-3,6-7H2,1H3,(H,16,17,20)